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P-22751850

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Name File
SDF P-22751850.sdf
SMILES P-22751850.smiles
Standard InChI P-22751850.inchi
InChIKey P-22751850.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-22751850 TimTec ActiMol 3 Week 90 in stock
Property Value
Components 1
Mass 352.433
logP 2.8076
H-bond acceptors 7
H-bond donors 1
Rotatable bonds 7
PSA 77.63
RO5 violations 0
RO3 violations 4
Refractivity 100.2072
Atoms 50
Rings 4
Heavy atoms 26
Hydrogen atoms 24
Heteroatoms 7
N/O atoms 7
Inorganic atoms 0
Halogen atoms 0
Chiral centers 1
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 1
Stereo double bonds 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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